N-(3,5-dimethoxyphenyl)-5-(4-fluorophenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-(3,5-dimethoxyphenyl)-5-(4-fluorophenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
N-(3,5-dimethoxyphenyl)-5-(4-fluorophenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
Compound ID: | J093-0030 |
Compound Name: | N-(3,5-dimethoxyphenyl)-5-(4-fluorophenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide |
Molecular Weight: | 461.37 |
Molecular Formula: | C21 H15 F4 N5 O3 |
Smiles: | COc1cc(cc(c1)OC)NC(c1nc2nc(cc(C(F)(F)F)n2n1)c1ccc(cc1)F)=O |
Stereo: | ACHIRAL |
logP: | 4.5811 |
logD: | 4.5801 |
logSw: | -4.4014 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 67.96 |
InChI Key: | GYILCUJIDRCRMB-UHFFFAOYSA-N |